Vitas-M small molecule compound
{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}{4-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl}methanone
Catalog ID
STL396743
SMILES Cn1ncc(c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H25N7O5S MW 487.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N7O5S/c1-15-20(28(30)31)16(2)27(23-15)13-17-4-6-18(7-5-17)21(29)25-8-10-26(11-9-25)34(32,33)19-12-22-24(3)14-19/h4-7,12,14H,8-11,13H2,1-3H3InChIKey
ZCGFYDWUVOEKND-UHFFFAOYSA-NSynonyms
1005685-60-8(4((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)PHENYL)(4((1METHYL1HPYRAZOL4YL)SULFONYL)PIPERAZIN1YL)METHANONE
(4((35dimethyl4nitropyrazol1yl)methyl)phenyl)(4(1methylpyrazol4yl)sulfonylpiperazin1yl)methanone
1005685608
4((35DIMETHYL4NITROPYRAZOLYL)METHYL)PHENYL4((1METHYLPYRAZOL4YL)SULFONYL)PIPERAZINYLKETONE
CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(N=C4)C)C)(N+)(=O)(O)
Cn1ncc(c1)S(=O)(=O)N1CCN(CC1)C(=O)c1ccc(cc1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC21H25N7O5Sc11520(28(30)31)16(2)27(2315)13174618(7517)21(29)2581026(11925)34(3233)19122224(3)1419h471214H81113H213H3
MFCD04135894
ZINC000002805227
ZINC02805227
ZINC2805227
Check stock
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Check stock on Vitas-MAvailable files
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